2-amino-5-(tetrazol-1-yl)pentanoic acid

C6H11N5O2 — CID 67379465

IUPAC2-amino-5-(tetrazol-1-yl)pentanoic acid
SMILESNC(CCCn1cnnn1)C(=O)O
InChIInChI=1S/C6H11N5O2/c7-5(6(12)13)2-1-3-11-4-8-9-10-11/h4-5H,1-3,7H2,(H,12,13)
InChIKeyJVIXMAZLCLQDFQ-UHFFFAOYSA-N
MW185.19 g/mol
LogP-1.13
Rot. Bonds5

About 2-amino-5-(tetrazol-1-yl)pentanoic acid

2-amino-5-(tetrazol-1-yl)pentanoic acid (PubChem CID 67379465) has the molecular formula C6H11N5O2 and a molecular weight of 185.19 g/mol. Its IUPAC name is 2-amino-5-(tetrazol-1-yl)pentanoic acid.

Molecular Properties

Compound Name2-amino-5-(tetrazol-1-yl)pentanoic acid
PubChem CID67379465
Molecular FormulaC6H11N5O2
Molecular Weight185.19 g/mol
Exact Mass185.09
IUPAC Name2-amino-5-(tetrazol-1-yl)pentanoic acid
SMILESNC(CCCn1cnnn1)C(=O)O
InChIInChI=1S/C6H11N5O2/c7-5(6(12)13)2-1-3-11-4-8-9-10-11/h4-5H,1-3,7H2,(H,12,13)
InChIKeyJVIXMAZLCLQDFQ-UHFFFAOYSA-N
XLogP-1.13
TPSA106.92 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 5-1.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(tetrazol-1-yl)pentanoic acid?
The IUPAC name of 2-amino-5-(tetrazol-1-yl)pentanoic acid (CID 67379465) is 2-amino-5-(tetrazol-1-yl)pentanoic acid.
What is the SMILES notation for 2-amino-5-(tetrazol-1-yl)pentanoic acid?
The canonical SMILES for 2-amino-5-(tetrazol-1-yl)pentanoic acid is NC(CCCn1cnnn1)C(=O)O.
What is the InChIKey of 2-amino-5-(tetrazol-1-yl)pentanoic acid?
The InChIKey is JVIXMAZLCLQDFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5O2/c7-5(6(12)13)2-1-3-11-4-8-9-10-11/h4-5H,1-3,7H2,(H,12,13).
What are the key properties of 2-amino-5-(tetrazol-1-yl)pentanoic acid?
2-amino-5-(tetrazol-1-yl)pentanoic acid has a molecular weight of 185.19 g/mol, XLogP of -1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(tetrazol-1-yl)pentanoic acid is sourced from PubChem (CID 67379465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).